Falcarinol
Representations & DB's id
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| ChEBI: | CHEBI:81095 | |
|---|---|---|
| ChEMBL: | CHEMBL368712 | |
| PubChem: | 5469789 | |
| IUPAC: | (3S,9Z)-heptadeca-1,9-dien-4,6-diyn-3-ol | |
| Standard InChI: | InChI=1S/C17H24O/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(18)4-2/h4,10-11,17-18H,2-3,5-9,12H2,1H3/b11-10-/t17-/m0/s1 | |
| Standard InChI Key: | UGJAEDFOKNAMQD-MQNTZWLQSA-N | |
| SMILES: | CCCCCCC/C=CCC#CC#C[C@H](C=C)O | |
Molecular propeties
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| AlogP: | 3.85 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 8 | |
| Number of rings: | 0 | |
| Molecular Weight: | 244.18 | |
| Topological polar surface area: | 20.2 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 0.529 | |
| Number of carbons: | 17 | |
Plant sources
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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